SCHEMBL22100178

SCHEMBL22100178

Clc1cc(I)ccc1N1COc2cc(I)ccc2C1

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
GAA P10253 2/20 0.33
KDM4E B2RXH2 1/20 0.33
RAD52 P43351 1/20 0.33
ALDH1A1 P00352 2/20 0.32
POLB P06746 1/20 0.32
LMNA P02545 1/20 0.32
MAPK1 P28482 1/20 0.32
HTT P42858 1/20 0.32
ALDH1A3 P47895 2/20 0.31
ALDH3A1 P30838 1/20 0.31
CYP3A4 P08684 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C9 P11712 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL22100181 0.90 MAPT (0.39) MAPTSMN1; SMN2GAAKDM4ERAD52
SCHEMBL22074251 0.88 MAPT (0.38) MAPTSMN1; SMN2GAAKDM4ERAD52
SCHEMBL22133009 0.81 MAPT (0.42) MAPTSMN1; SMN2GAAKDM4ERAD52
SCHEMBL22100183 0.81 DRD2 (0.36) MAPTSMN1; SMN2GAAALDH1A1LMNA
SCHEMBL22074309 0.73 SMN1; SMN2 (0.40) MAPTSMN1; SMN2GAAALDH1A1POLB
SCHEMBL20180555 0.68 KDM4E (0.64) MAPTSMN1; SMN2GAAKDM4ERAD52
SCHEMBL17875588 0.68 MAPT (0.46) MAPTSMN1; SMN2GAAALDH1A1POLB
SCHEMBL20041209 0.65 CASP3 (0.37) ALDH1A1HTT
SCHEMBL20865773 0.65 MAPT (0.41) MAPTSMN1; SMN2GAAALDH1A1LMNA
SCHEMBL10020845 0.64 ALDH1A1 (0.36) MAPTSMN1; SMN2GAAALDH1A1HTT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11208371-B2 Compounds, compositions, and methods for use in treating autophagy-associated disorders BIOPHAGY INC (US) 2021-12-28 US disclosed
WO-2020131924-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR USE IN TREATING AUTOPHAGY-ASSOCIATED DISORDERS Biophagy, Inc. (US) 2020-06-25 WO disclosed
US-20200190007-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR USE IN TREATING AUTOPHAGY-ASSOCIATED DISORDERS BIOPHAGY INC (US) 2020-06-18 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20200190007-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR USE IN TREATING AUTOPHAGY-ASSOCIATED DISORDERS BECN1, ATG7, SQSTM1 MAPT 33/4885SMN1; SMN2 440/4885GAA 15/4885
US-11208371-B2 Compounds, compositions, and methods for use in treating autophagy-associated disorders BECN1, ATG7, SQSTM1 MAPT 33/4885SMN1; SMN2 440/4885GAA 15/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.